2-(11-ethylsulfanylundecanoylamino)-2-phenyl-butanoic acid

Systemtic Name: 2-(11-ethylsulfanylundecanoylamino)-2-phenyl-butanoic acid Openeye Name: 2-(11-ethylsulfanylundecanoylamino)-2-phenyl-butanoic acid CAS Name: 2-[[11-(ethylthio)-1-oxoundecyl]amino]-2-phenylbutanoic acid IUPAC Name: 2-(11-ethylsulfanylundecanoylamino)-2-phenylbutanoic acid Traditional Name: 2-[11-(ethylthio)undecanoylamino]-2-phenyl-butyric acid Formula: C23H37NO3S MolecularWeight: 407.60978

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)(C(=O)O)NC(=O)CCCCCCCCCCSCC

Isomeric SMILES

CCC(C1=CC=CC=C1)(C(=O)O)NC(=O)CCCCCCCCCCSCC

InChI

InChI=1S/C23H37NO3S/c1-3-23(22(26)27,20-16-12-11-13-17-20)24-21(25)18-14-9-7-5-6-8-10-15-19-28-4-2/h11-13,16-17H,3-10,14-15,18-19H2,1-2H3,(H,24,25)(H,26,27)